3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide

C16H16ClN3O2 — CID 38139828

IUPAC3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide
SMILESO=C(Nc1ccc(N2CCOCC2)cn1)c1cccc(Cl)c1
InChIInChI=1S/C16H16ClN3O2/c17-13-3-1-2-12(10-13)16(21)19-15-5-4-14(11-18-15)20-6-8-22-9-7-20/h1-5,10-11H,6-9H2,(H,18,19,21)
InChIKeyLMFDQQRSLULIDP-UHFFFAOYSA-N
MW317.78 g/mol
LogP2.82
Rot. Bonds3

About 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide

3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide (PubChem CID 38139828) has the molecular formula C16H16ClN3O2 and a molecular weight of 317.78 g/mol. Its IUPAC name is 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide
PubChem CID38139828
Molecular FormulaC16H16ClN3O2
Molecular Weight317.78 g/mol
Exact Mass317.09
IUPAC Name3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide
SMILESO=C(Nc1ccc(N2CCOCC2)cn1)c1cccc(Cl)c1
InChIInChI=1S/C16H16ClN3O2/c17-13-3-1-2-12(10-13)16(21)19-15-5-4-14(11-18-15)20-6-8-22-9-7-20/h1-5,10-11H,6-9H2,(H,18,19,21)
InChIKeyLMFDQQRSLULIDP-UHFFFAOYSA-N
XLogP2.82
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.78
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-(5-morpholin-4-yl-2-pyridinyl)pyridine-4-carboxamide
CID 33447939
N-(5-morpholin-4-yl-2-pyridinyl)-3-(tetrazol-1-yl)benzamide
CID 134053219
N-[3-[(5-morpholin-4-yl-2-pyridinyl)carbamoyl]phenyl]pyridine-3-carboxamide
CID 55634320
4-fluoro-3,5-dimethyl-N-(5-morpholin-4-yl-2-pyridinyl)benzamide
CID 146084918
5-chloro-N-(5-morpholin-4-yl-2-pyridinyl)-1H-indole-2-carboxamide
CID 134002725
3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide
CID 113025354
N-[2-[(5-morpholin-4-yl-2-pyridinyl)amino]-2-oxoethyl]benzamide
CID 38141318
3,4,5,6-tetrachloro-N-(5-morpholin-4-yl-2-pyridinyl)pyridine-2-carboxamide
CID 56573813
6-methoxy-N-(5-morpholin-4-yl-2-pyridinyl)pyridine-3-carboxamide
CID 134053283
N-(5-morpholin-4-yl-2-pyridinyl)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 38143196
N-[5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-pyridinyl]-3-fluorobenzamide
CID 113029120
3-chloro-N-(5-chloro-2-morpholin-4-ylphenyl)benzamide
CID 5096755

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide?
The IUPAC name of 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide (CID 38139828) is 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide.
What is the SMILES notation for 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide?
The canonical SMILES for 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide is O=C(Nc1ccc(N2CCOCC2)cn1)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide?
The InChIKey is LMFDQQRSLULIDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClN3O2/c17-13-3-1-2-12(10-13)16(21)19-15-5-4-14(11-18-15)20-6-8-22-9-7-20/h1-5,10-11H,6-9H2,(H,18,19,21).
What are the key properties of 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide?
3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide has a molecular weight of 317.78 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide is sourced from PubChem (CID 38139828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).